@MOLECULE (e)-n-{2-[({5-[(dimethylamino)methyl]-2-furyl}methyl)sulfinyl]ethyl}-n'-methyl-2-nitro-1,1-ethenediamine 44 44 0 0 0 SMALL GASTEIGER @ATOM 1 S 0.5606 0.3442 -0.2864 S.O 1 UNL111111111111 1.1589 2 O 3.8753 0.8157 0.5034 O.2 1 UNL111111111111 -0.2026 3 O 0.6189 -0.6451 0.8074 O.2 1 UNL111111111111 -0.7702 4 O -7.0045 -1.1241 -0.2567 O.2 1 UNL111111111111 -0.5604 5 O -5.8885 -2.8576 -0.8588 O.2 1 UNL111111111111 -0.4238 6 N 6.1784 -1.5129 0.0845 N.3 1 UNL111111111111 -0.3701 7 N -3.4405 0.9651 0.2919 N.pl3 1 UNL111111111111 -0.5528 8 N -5.7653 0.9587 0.6773 N.pl3 1 UNL111111111111 -0.5090 9 N -5.9220 -1.7102 -0.4380 N.pl3 1 UNL111111111111 0.7263 10 C 1.6878 1.7329 0.2020 C.3 1 UNL111111111111 -0.5281 11 C 3.0053 1.4596 -0.3635 C.ar 1 UNL111111111111 0.1081 12 C -1.0330 1.2521 -0.0057 C.3 1 UNL111111111111 -0.5514 13 C 5.0529 0.6164 -0.2014 C.ar 1 UNL111111111111 0.1176 14 C 6.0872 -0.1077 0.5702 C.3 1 UNL111111111111 -0.1361 15 C -2.1735 0.2386 0.0578 C.3 1 UNL111111111111 -0.0423 16 C 3.6158 1.6791 -1.5716 C.ar 1 UNL111111111111 -0.2426 17 C 4.9437 1.1319 -1.4645 C.ar 1 UNL111111111111 -0.2344 18 C 4.8918 -2.2208 0.2571 C.3 1 UNL111111111111 -0.2888 19 C 7.2574 -2.2206 0.8096 C.3 1 UNL111111111111 -0.2830 20 C -4.6457 0.2830 0.2666 C.2 1 UNL111111111111 0.5129 21 C -4.7265 -1.0477 -0.1645 C.2 1 UNL111111111111 -0.5690 22 C -5.7993 2.4045 0.8741 C.3 1 UNL111111111111 -0.2409 23 H 1.7374 1.8024 1.3117 H 1 UNL111111111111 0.1973 24 H 1.2929 2.7043 -0.1469 H 1 UNL111111111111 0.1777 25 H -1.1836 1.9636 -0.8346 H 1 UNL111111111111 0.1697 26 H -0.9858 1.8457 0.9209 H 1 UNL111111111111 0.1593 27 H 7.0839 0.3718 0.4019 H 1 UNL111111111111 0.1644 28 H 5.8767 -0.0381 1.6650 H 1 UNL111111111111 0.1433 29 H -2.0002 -0.5152 0.8695 H 1 UNL111111111111 0.1680 30 H -2.2676 -0.3222 -0.9060 H 1 UNL111111111111 0.1642 31 H 3.2175 2.1541 -2.4412 H 1 UNL111111111111 0.1664 32 H 5.6787 1.1258 -2.2410 H 1 UNL111111111111 0.1735 33 H -3.3624 1.7932 0.8666 H 1 UNL111111111111 0.3047 34 H 4.1212 -1.7287 -0.3628 H 1 UNL111111111111 0.1558 35 H 4.5201 -2.2547 1.2921 H 1 UNL111111111111 0.1300 36 H 4.9947 -3.2524 -0.1162 H 1 UNL111111111111 0.1479 37 H 8.2183 -1.7198 0.6074 H 1 UNL111111111111 0.1437 38 H 7.3387 -3.2454 0.4090 H 1 UNL111111111111 0.1500 39 H 7.1138 -2.2846 1.8982 H 1 UNL111111111111 0.1230 40 H -6.6736 0.4830 0.4991 H 1 UNL111111111111 0.3734 41 H -3.8323 -1.6474 -0.3110 H 1 UNL111111111111 0.2109 42 H -5.1991 2.7021 1.7525 H 1 UNL111111111111 0.1436 43 H -6.8426 2.7198 1.0726 H 1 UNL111111111111 0.1696 44 H -5.4433 2.9623 -0.0107 H 1 UNL111111111111 0.1452 @BOND 1 1 3 2 2 1 10 1 3 1 12 1 4 2 11 ar 5 2 13 ar 6 4 9 2 7 5 9 2 8 6 14 1 9 6 18 1 10 6 19 1 11 7 15 1 12 7 20 1 13 7 33 1 14 8 20 1 15 8 22 1 16 8 40 1 17 9 21 1 18 10 11 1 19 10 23 1 20 10 24 1 21 11 16 ar 22 12 15 1 23 12 25 1 24 12 26 1 25 13 14 1 26 13 17 ar 27 14 27 1 28 14 28 1 29 15 29 1 30 15 30 1 31 16 17 ar 32 16 31 1 33 17 32 1 34 18 34 1 35 18 35 1 36 18 36 1 37 19 37 1 38 19 38 1 39 19 39 1 40 20 21 2 41 21 41 1 42 22 42 1 43 22 43 1 44 22 44 1